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CHEBI:107214 - 4,5-dimethoxy-2-[(1-oxo-2-thiophen-2-ylethyl)amino]benzoic acid methyl ester

ChEBI IDCHEBI:107214
ChEBI Name4,5-dimethoxy-2-[(1-oxo-2-thiophen-2-ylethyl)amino]benzoic acid methyl ester
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FormulaC16H17NO5S
Net Charge0
Average Mass335.381
Monoisotopic Mass335.08274
SMILESCOC(=O)c1cc(OC)c(OC)cc1NC(=O)Cc1cccs1
InChIInChI=1S/C16H17NO5S/c1-20-13-8-11(16(19)22-3)12(9-14(13)21-2)17-15(18)7-10-5-4-6-23-10/h4-6,8-9H,7H2,1-3H3,(H,17,18)
InChIKeyGWIRYOOQAMFEDV-UHFFFAOYSA-N
Roles Classification
Chemical Role:
Bronsted acid  A molecular entity capable of donating a hydron to an acceptor (Brønsted base).
ChEBI Ontology
Outgoing Relation(s)
4,5-dimethoxy-2-[(1-oxo-2-thiophen-2-ylethyl)amino]benzoic acid methyl ester (CHEBI:107214) is a amidobenzoic acid (CHEBI:48470)
Manual XrefsDatabases
LSM-18568LINCS